6D5C
Structure of Caldicellulosiruptor danielii GH10 module of glycoside hydrolase WP_045175321
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | BRUKER AXS MICROSTAR |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2016-05-31 |
Detector | Bruker Platinum 135 |
Wavelength(s) | 1.5418 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 173.307, 98.497, 78.810 |
Unit cell angles | 90.00, 93.58, 90.00 |
Refinement procedure
Resolution | 86.480 - 1.900 |
R-factor | 0.18147 |
Rwork | 0.179 |
R-free | 0.23331 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5ay7 |
RMSD bond length | 0.019 |
RMSD bond angle | 1.804 |
Data reduction software | SAINT |
Data scaling software | PROTEUM PLUS |
Phasing software | MOLREP |
Refinement software | REFMAC (5.8.0158) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.000 |
High resolution limit [Å] | 1.900 | 1.900 |
Number of reflections | 104001 | 14807 |
<I/σ(I)> | 14.32 | 2.11 |
Completeness [%] | 100.0 | 100 |
Redundancy | 6.03 | 3.54 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 293 | 0.1 M Tris, pH 8-9, 1.5-2.1 M ammonium sulfate |